Product Name

  • Name

    DEUTERIUM OXIDE

  • EINECS 232-148-9
  • CAS No. 7789-20-0
  • Article Data111
  • CAS DataBase
  • Density 1.11 g/cm3
  • Solubility Miscible with water.
  • Melting Point 3.8 °C(lit.)
  • Formula D2O
  • Boiling Point 100 °C at 760 mmHg
  • Molecular Weight 19.9994
  • Flash Point 101.4 °C
  • Transport Information
  • Appearance colourless liquid
  • Safety 24/25
  • Risk Codes
  • Molecular Structure Molecular Structure of 7789-20-0 (DEUTERIUM OXIDE)
  • Hazard Symbols
  • Synonyms Water,heavy (D2O) (8CI);Deuterium oxide;Deuterium oxide (D2O);Deuterium oxide-d2;Dideuterium monoxide;Dideuterium oxide;Heavy water;Heavy water (D2O);Heavywater-d2;Water-2H2;
  • PSA 9.23000
  • LogP -0.06430

Synthetic route

deuteroxyl
13587-54-7

deuteroxyl

nitric acid-d1
13587-52-5

nitric acid-d1

A

water-d2
7789-20-0

water-d2

B

nitrate radical
12033-49-7, 807306-99-6

nitrate radical

Conditions
ConditionsYield
In gaseous matrix Kinetics; Irradiation (UV/VIS); photolysis in Pyrex vessel, gas flow velocity: 5-10 cms**-1, T: 239.7-, 370.1 K, p: 20-199.7 Torr, buffer gas: He, SF6;A n/a
B 0.95%
In neat (no solvent) Kinetics; 263-446 K, 1-20 Torr;
With sulfur(VI) hexafluoride In neat (no solvent) Kinetics; 263-446 K, 1-107 Torr;
2Na(1+)*SO4(2-)*10(2)H2O=Na2SO4*10(2)H2O

2Na(1+)*SO4(2-)*10(2)H2O=Na2SO4*10(2)H2O

A

water-d2
7789-20-0

water-d2

B

sodium sulfate
7757-82-6

sodium sulfate

Conditions
ConditionsYield
In not given 34.2°C;;
deuterium
16873-17-9

deuterium

water-d2
7789-20-0

water-d2

Conditions
ConditionsYield
In not given byproducts: H(2)H; equilibrium constant discussed;;
In not given byproducts: (2)HH; equilibrium constant discussed;;
In not given byproducts: (2)HH; equilibrium discussed;;
In not given byproducts: (2)HH; equilibrium constant discussed;;
water
7732-18-5

water

deuterium
16873-17-9

deuterium

A

hydrogen
1333-74-0

hydrogen

B

water-d2
7789-20-0

water-d2

Conditions
ConditionsYield
In neat (no solvent, gas phase) hydrogen-isotope-exchange reaction studied in electrochem. double cells;
water
7732-18-5

water

deuterium
16873-17-9

deuterium

water-d2
7789-20-0

water-d2

Conditions
ConditionsYield
In not given byproducts: H2; thermodynamic data discussed;;
With catalyst: Pd on activated charcoal; In neat (no solvent)
In not given byproducts: H; equilibrium constant discussed;;
hydrogen sulfide
7783-06-4

hydrogen sulfide

water
7732-18-5

water

water-d2
7789-20-0

water-d2

Conditions
ConditionsYield
production of D2O by H/D exchange;
production of D2O by H/D exchange;
hydroxide ion-d1
17693-79-7

hydroxide ion-d1

deuterium cation

deuterium cation

water-d2
7789-20-0

water-d2

Conditions
ConditionsYield
In not given Kinetics;
In not given Kinetics;
dideuterioformic acid
920-42-3

dideuterioformic acid

A

carbon monoxide
201230-82-2

carbon monoxide

B

water-d2
7789-20-0

water-d2

Conditions
ConditionsYield
rutile In neat (no solvent) Kinetics; byproducts: formaldehyde, CO2, (2)H2; other Radiation; decompn. on stoch. and defective surfaces of TiO2(110) rutile single crystal at 400-613 K; yields of CO and (2)H2O were about 60 %; (2)H2CO and CO2 - about 10 %; (2)H2 -about 2 %; detd. by TPRS;
iron(II) oxide
1345-25-1

iron(II) oxide

deuterium
16873-17-9

deuterium

water-d2
7789-20-0

water-d2

Conditions
ConditionsYield
In not given byproducts: Fe; equilibrium constant discussed;;
water-d2
7789-20-0

water-d2

Conditions
ConditionsYield
In solid pressurizing (77 K, 15 kbar), releasing pressure (liq. N2), transferring(aluminium container), evacuating (20 mbar), cooling (5 or 15 K);
silver tetrafluoroborate
14104-20-2

silver tetrafluoroborate

(η5-pentamethylcyclopentadienyl)ruthenium(II)chloro[bis(diphenylphosphanyl)methane]

(η5-pentamethylcyclopentadienyl)ruthenium(II)chloro[bis(diphenylphosphanyl)methane]

oxygen
80937-33-3

oxygen

deuterium
16873-17-9

deuterium

water-d2
7789-20-0

water-d2

Conditions
ConditionsYield
In acetone Sonication; sonicating (30 min), D2-atmosphere (1 h), air atmosphere (overnight); detd. by (2)D NMR spectroscopy;
deuterium

deuterium

oxygen

oxygen

water-d2
7789-20-0

water-d2

Conditions
ConditionsYield
In neat (no solvent) Kinetics; react. of D and O coadsorbed on Rh(100) surface at 90 K, heated in UHV between 140 and 240 K, formation of OD intermediate, heating higher than 240 K, H2O formed and evolved from surface; react. is monitored by electron energy loss spectroscopy and low energy electron diffraction;
oxygen

oxygen

deuterium
16873-17-9

deuterium

water-d2
7789-20-0

water-d2

Conditions
ConditionsYield
platinum In neat (no solvent) other Radiation; 200 Torr, microwave discharge, 440-913 K;
silane-d4
13537-07-0

silane-d4

monosilane
7440-21-3

monosilane

oxygen

oxygen

A

water-d2
7789-20-0

water-d2

B

water
14940-63-7

water

C

deuterium hydride

deuterium hydride

D

deuterium
16873-17-9

deuterium

Conditions
ConditionsYield
In gaseous matrix Kinetics; react. in a discharge flow system with MS spect. detection (O-atom generation by titration react. of N/NO), carrier gas Ar, room temp., pressure 400 Pa, coated reactor; product distribution; products not isolated, detd. by MS, GC;
deuterium
16873-17-9

deuterium

water-d2
7789-20-0

water-d2

Conditions
ConditionsYield
With αO in FeZSM-5 zeolite In neat (no solvent) Kinetics; -100 - +20 °C;
In neat (no solvent) zeolite treated at 550°C, surface α-oxygen formed by decomposing N2O at 250°C, interaction of deuterium with α-oxygen at 100°C, condensed products freezed in a trap at -196°C for 30 min;
With VO(x) on Pd(111) In neat (no solvent) oxidation of D2 on Pd(111) surface coated by VO(x) prepared by electron beam evaporation of V onto Pd at 523 K in O2 atmosphere of 2*10**-7 mbar; detd. by MAS;
hydrogen
1333-74-0

hydrogen

nitrogen(II) oxide
10102-43-9

nitrogen(II) oxide

deuterium
16873-17-9

deuterium

A

nitrogen
7727-37-9

nitrogen

B

water
7732-18-5

water

C

water-d2
7789-20-0

water-d2

D

water
14940-63-7

water

Conditions
ConditionsYield
With catalyst: Pd/Ce-Zr-La-γ-alumina In neat (no solvent) Kinetics; byproducts: N2O, NH3, NH2(2)H; Ar; at 155+/-3°C, at atm. pressure; further by-products: NH(2)H2,N(2)H3; MS;
hydrogen
1333-74-0

hydrogen

oxygen
80937-33-3

oxygen

deuterium
16873-17-9

deuterium

A

water
7732-18-5

water

B

water-d2
7789-20-0

water-d2

C

water
14940-63-7

water

Conditions
ConditionsYield
platinum In gaseous matrix 200 mTorr; not isolated; IR spectroscopy;
carbon monoxide
201230-82-2

carbon monoxide

deuterium
16873-17-9

deuterium

water-d2
7789-20-0

water-d2

Conditions
ConditionsYield
Kinetics; byproducts: CH4; up to various time on Ni/SiO2 catalyst; D2O detd. by trapping at 77 K, followed analysis using gas chromy.;
rhodium In neat (no solvent) byproducts: CD4; methanation on Rh surface at 10**-8Torr and 150K using pulsed-laser image atom-probe; studying atomic steps of react.;; detn. react. intermediates by time-of-flight mass spectrum;;
12-molybdophosphoric acid
12026-57-2

12-molybdophosphoric acid

deuterium
16873-17-9

deuterium

A

PMo12O39(3-)

PMo12O39(3-)

B

water-d2
7789-20-0

water-d2

Conditions
ConditionsYield
In neat (no solvent) Kinetics; react. of H2-D2 over PMo12 at 573 K; initial pressures of H2: 12 Torr, D2 20 Torr; detn. of pressure decrease; evolved water detd. volumetrically;
nitrogen(II) oxide
10102-43-9

nitrogen(II) oxide

deuterium
16873-17-9

deuterium

A

nitrogen
7727-37-9

nitrogen

B

water-d2
7789-20-0

water-d2

Conditions
ConditionsYield
platinum 300 K;
oxygen
80937-33-3

oxygen

deuterium
16873-17-9

deuterium

A

water
7732-18-5

water

B

water-d2
7789-20-0

water-d2

Conditions
ConditionsYield
With air; hydrogen; LaNi5(2)H6.7 room temp.;A 0%
B n/a
oxygen
80937-33-3

oxygen

deuterium
16873-17-9

deuterium

water-d2
7789-20-0

water-d2

Conditions
ConditionsYield
copper(II) oxide In not given Kinetics;
nickel(II) oxide In not given Kinetics;
platinum Kinetics; water formation on Pt;
methane
34557-54-5

methane

carbon dioxide
124-38-9

carbon dioxide

deuterium
16873-17-9

deuterium

A

carbon monoxide
201230-82-2

carbon monoxide

B

water
7732-18-5

water

C

hydrogen
1333-74-0

hydrogen

D

water-d2
7789-20-0

water-d2

E

water
14940-63-7

water

Conditions
ConditionsYield
With catalyst:7 wtpercentNi/MgO In neat (no solvent) Kinetics; byproducts: HDO; 7 wt% Ni/MgO as catalyst, CH4:CO2:D2=1:1:0.2, 973 K, 16.7 kPa CH4 and CO2, resp., 3.3 kPa D2, 100 kPa total pressure, Ar as balance, HDO was also formed; monitored by MS;
deuterium
16873-17-9

deuterium

dinitrogen monoxide
10024-97-2

dinitrogen monoxide

A

nitrogen
7727-37-9

nitrogen

B

water-d2
7789-20-0

water-d2

Conditions
ConditionsYield
nickel Kinetics; at 124-192 °C,total pressure:15 mmHg;
With catalysts: Ir/Al2O3 Kinetics; at 393-473°C;
With catalysts: Pt/Al2O3 Kinetics; at 393-473°C;
tin(IV) oxide

tin(IV) oxide

deuterium
16873-17-9

deuterium

water-d2
7789-20-0

water-d2

Conditions
ConditionsYield
In not given byproducts: Sn; equilibrium constant discussed;;
In not given byproducts: Sn;
In not given byproducts: Sn;
deuteroxyl
13587-54-7

deuteroxyl

deuterium
16873-17-9

deuterium

A

water-d2
7789-20-0

water-d2

B

deuterium

deuterium

Conditions
ConditionsYield
In neat (no solvent) Kinetics;
carbon dioxide
124-38-9

carbon dioxide

deuterium
16873-17-9

deuterium

A

water
7732-18-5

water

B

water-d2
7789-20-0

water-d2

C

water
14940-63-7

water

Conditions
ConditionsYield
With methane In neat (no solvent) reaction of CH4/CO2/D2/Ar mixt. at 873 K on catalyst Ru/Al2O3 studied; MS;
With methane In gas react. of CH4/CO2/(2)H2 mixt. on Pt/(ZrO2-CeO2) at 873 K led to production of water isotopomers; MS;
methane
34557-54-5

methane

methane
558-20-3

methane

carbon dioxide
124-38-9

carbon dioxide

A

carbon monoxide
201230-82-2

carbon monoxide

B

water
7732-18-5

water

C

water-d2
7789-20-0

water-d2

D

pyrographite
7440-44-0

pyrographite

E

water
14940-63-7

water

Conditions
ConditionsYield
With catalyst:7 wtpercentNi/MgO In neat (no solvent) Kinetics; byproducts: CHD3, CH2D2, CH3D; 7 wt% Ni/MgO as catalyst, CH4:CD4:H2O=1:1:2, 873-973 K, 12.5 kPa CH4 andCD4, resp., 25 kPa CO2, 100 kPa total pressure, Ar as balance; monitored by MS;
methane
558-20-3

methane

carbon dioxide
124-38-9

carbon dioxide

A

carbon monoxide
201230-82-2

carbon monoxide

B

water-d2
7789-20-0

water-d2

C

pyrographite
7440-44-0

pyrographite

D

deuterium
16873-17-9

deuterium

Conditions
ConditionsYield
With catalyst:7 wtpercentNi/MgO In neat (no solvent) Kinetics; 7 wt% Ni/MgO as catalyst, 20 kPa CD4 and 25 kPa CO2 pressure, resp., He as balance, 100-1500 kPa total pressure, 873 K;
oxygen
80937-33-3

oxygen

hydroxide ion-d1
17693-79-7

hydroxide ion-d1

water-d2
7789-20-0

water-d2

Conditions
ConditionsYield
rutile In neat (no solvent) react. at oxygen vacancy defects on surface of rutile TiO2(110); detd. by TPD;
cerium(III) oxide

cerium(III) oxide

water-d2
7789-20-0

water-d2

ceriumsulfate octahydrate-d2

ceriumsulfate octahydrate-d2

Conditions
ConditionsYield
With sulfuric acid In hydrogenchloride dissolving the cerium oxide in dil. HCl adding the equiv. amt. of 0.1 NH2SO4 to yield a quant. amt. of sulfate which was pptd. as small needles by the addn. of an excess of ethyl alcohol; the crystals were filteredoff; washed with water/alcohol, purifn. by crystn., dehydration under vac. at 380°C; after sufficient dehydration the compound was dissolved in D2O at about 4°C;100%
(η5:η5-fulvalene)pentacarbonyl(1-oxacyclopent-2-ylidene)dimolybdenum

(η5:η5-fulvalene)pentacarbonyl(1-oxacyclopent-2-ylidene)dimolybdenum

deuteromethanol
1455-13-6

deuteromethanol

water-d2
7789-20-0

water-d2

(η5:η5-fulvalene)pentacarbonyl(3,3-dideuterio-1-oxacyclopent-2-ylidene)dimolybdenum

(η5:η5-fulvalene)pentacarbonyl(3,3-dideuterio-1-oxacyclopent-2-ylidene)dimolybdenum

Conditions
ConditionsYield
With sodium methoxide In tetrahydrofuran; deuteromethanol MeONa added to soln. of ((C5H4)2)Mo2(CO)5(C(CH2)3O) in THF and CH3OD, reacted for 5 min; filtered through short column of alumina deactivated with D2O, eluted with THF, rotary evapd.;100%
((CH3)5C5)W(NO)(OH)(η(2)-HN=C(Me)CH=CPh)
188759-75-3

((CH3)5C5)W(NO)(OH)(η(2)-HN=C(Me)CH=CPh)

water-d2
7789-20-0

water-d2

((CH3)5C5)W(NO)(OD)(η(2)-DN=C(Me)CH=CPh)
202531-09-7

((CH3)5C5)W(NO)(OD)(η(2)-DN=C(Me)CH=CPh)

Conditions
ConditionsYield
In [D3]acetonitrile N2 or Ar-atmosphere, NMR tube; 45°C (overnight); not isolated, detd. by NMR spectroscopy;100%
((CH3)5C5)W(NO)(η(3)-HNC(Me)=NC(=CH2)CH=CPh)
188759-74-2

((CH3)5C5)W(NO)(η(3)-HNC(Me)=NC(=CH2)CH=CPh)

water-d2
7789-20-0

water-d2

((CH3)5C5)W(NO)(η(3)-DNC(CD3)=NC(=CD2)CH=CPh)
202531-10-0

((CH3)5C5)W(NO)(η(3)-DNC(CD3)=NC(=CD2)CH=CPh)

Conditions
ConditionsYield
In tetrahydrofuran-d8 N2 or Ar-atmosphere; 55°C (48 h); not isolated, detd. by NMR spectroscopy;100%
deuteroxyl
13587-54-7

deuteroxyl

nitric acid-d1
13587-52-5

nitric acid-d1

A

water-d2
7789-20-0

water-d2

B

nitrate radical
12033-49-7, 807306-99-6

nitrate radical

Conditions
ConditionsYield
In gaseous matrix Kinetics; Irradiation (UV/VIS); photolysis in Pyrex vessel, gas flow velocity: 5-10 cms**-1, T: 239.7-, 370.1 K, p: 20-199.7 Torr, buffer gas: He, SF6;A n/a
B 0.95%
In neat (no solvent) Kinetics; 263-446 K, 1-20 Torr;
With sulfur(VI) hexafluoride In neat (no solvent) Kinetics; 263-446 K, 1-107 Torr;
2Na(1+)*SO4(2-)*10(2)H2O=Na2SO4*10(2)H2O

2Na(1+)*SO4(2-)*10(2)H2O=Na2SO4*10(2)H2O

A

water-d2
7789-20-0

water-d2

B

sodium sulfate
7757-82-6

sodium sulfate

Conditions
ConditionsYield
In not given 34.2°C;;
deuterium
16873-17-9

deuterium

water-d2
7789-20-0

water-d2

Conditions
ConditionsYield
In not given byproducts: H(2)H; equilibrium constant discussed;;
In not given byproducts: (2)HH; equilibrium constant discussed;;
In not given byproducts: (2)HH; equilibrium discussed;;
In not given byproducts: (2)HH; equilibrium constant discussed;;
water
7732-18-5

water

deuterium
16873-17-9

deuterium

A

hydrogen
1333-74-0

hydrogen

B

water-d2
7789-20-0

water-d2

Conditions
ConditionsYield
In neat (no solvent, gas phase) hydrogen-isotope-exchange reaction studied in electrochem. double cells;
water
7732-18-5

water

deuterium
16873-17-9

deuterium

water-d2
7789-20-0

water-d2

Conditions
ConditionsYield
In not given byproducts: H2; thermodynamic data discussed;;
With catalyst: Pd on activated charcoal; In neat (no solvent)
In not given byproducts: H; equilibrium constant discussed;;
hydrogen sulfide
7783-06-4

hydrogen sulfide

water
7732-18-5

water

water-d2
7789-20-0

water-d2

Conditions
ConditionsYield
production of D2O by H/D exchange;
production of D2O by H/D exchange;
hydroxide ion-d1
17693-79-7

hydroxide ion-d1

deuterium cation

deuterium cation

water-d2
7789-20-0

water-d2

Conditions
ConditionsYield
In not given Kinetics;
In not given Kinetics;
dideuterioformic acid
920-42-3

dideuterioformic acid

A

carbon monoxide
201230-82-2

carbon monoxide

B

water-d2
7789-20-0

water-d2

Conditions
ConditionsYield
rutile In neat (no solvent) Kinetics; byproducts: formaldehyde, CO2, (2)H2; other Radiation; decompn. on stoch. and defective surfaces of TiO2(110) rutile single crystal at 400-613 K; yields of CO and (2)H2O were about 60 %; (2)H2CO and CO2 - about 10 %; (2)H2 -about 2 %; detd. by TPRS;
iron(II) oxide
1345-25-1

iron(II) oxide

deuterium
16873-17-9

deuterium

water-d2
7789-20-0

water-d2

Conditions
ConditionsYield
In not given byproducts: Fe; equilibrium constant discussed;;
water-d2
7789-20-0

water-d2

Conditions
ConditionsYield
In solid pressurizing (77 K, 15 kbar), releasing pressure (liq. N2), transferring(aluminium container), evacuating (20 mbar), cooling (5 or 15 K);
silver tetrafluoroborate
14104-20-2

silver tetrafluoroborate

(η5-pentamethylcyclopentadienyl)ruthenium(II)chloro[bis(diphenylphosphanyl)methane]

(η5-pentamethylcyclopentadienyl)ruthenium(II)chloro[bis(diphenylphosphanyl)methane]

oxygen
80937-33-3

oxygen

deuterium
16873-17-9

deuterium

water-d2
7789-20-0

water-d2

Conditions
ConditionsYield
In acetone Sonication; sonicating (30 min), D2-atmosphere (1 h), air atmosphere (overnight); detd. by (2)D NMR spectroscopy;
deuterium

deuterium

oxygen

oxygen

water-d2
7789-20-0

water-d2

Conditions
ConditionsYield
In neat (no solvent) Kinetics; react. of D and O coadsorbed on Rh(100) surface at 90 K, heated in UHV between 140 and 240 K, formation of OD intermediate, heating higher than 240 K, H2O formed and evolved from surface; react. is monitored by electron energy loss spectroscopy and low energy electron diffraction;
oxygen

oxygen

deuterium
16873-17-9

deuterium

water-d2
7789-20-0

water-d2

Conditions
ConditionsYield
platinum In neat (no solvent) other Radiation; 200 Torr, microwave discharge, 440-913 K;
silane-d4
13537-07-0

silane-d4

monosilane
7440-21-3

monosilane

oxygen

oxygen

A

water-d2
7789-20-0

water-d2

B

water
14940-63-7

water

C

deuterium hydride

deuterium hydride

D

deuterium
16873-17-9

deuterium

Conditions
ConditionsYield
In gaseous matrix Kinetics; react. in a discharge flow system with MS spect. detection (O-atom generation by titration react. of N/NO), carrier gas Ar, room temp., pressure 400 Pa, coated reactor; product distribution; products not isolated, detd. by MS, GC;
deuterium
16873-17-9

deuterium

water-d2
7789-20-0

water-d2

Conditions
ConditionsYield
With αO in FeZSM-5 zeolite In neat (no solvent) Kinetics; -100 - +20 °C;
In neat (no solvent) zeolite treated at 550°C, surface α-oxygen formed by decomposing N2O at 250°C, interaction of deuterium with α-oxygen at 100°C, condensed products freezed in a trap at -196°C for 30 min;
With VO(x) on Pd(111) In neat (no solvent) oxidation of D2 on Pd(111) surface coated by VO(x) prepared by electron beam evaporation of V onto Pd at 523 K in O2 atmosphere of 2*10**-7 mbar; detd. by MAS;
hydrogen
1333-74-0

hydrogen

nitrogen(II) oxide
10102-43-9

nitrogen(II) oxide

deuterium
16873-17-9

deuterium

A

nitrogen
7727-37-9

nitrogen

B

water
7732-18-5

water

C

water-d2
7789-20-0

water-d2

D

water
14940-63-7

water

Conditions
ConditionsYield
With catalyst: Pd/Ce-Zr-La-γ-alumina In neat (no solvent) Kinetics; byproducts: N2O, NH3, NH2(2)H; Ar; at 155+/-3°C, at atm. pressure; further by-products: NH(2)H2,N(2)H3; MS;
hydrogen
1333-74-0

hydrogen

oxygen
80937-33-3

oxygen

deuterium
16873-17-9

deuterium

A

water
7732-18-5

water

B

water-d2
7789-20-0

water-d2

C

water
14940-63-7

water

Conditions
ConditionsYield
platinum In gaseous matrix 200 mTorr; not isolated; IR spectroscopy;
carbon monoxide
201230-82-2

carbon monoxide

deuterium
16873-17-9

deuterium

water-d2
7789-20-0

water-d2

Conditions
ConditionsYield
Kinetics; byproducts: CH4; up to various time on Ni/SiO2 catalyst; D2O detd. by trapping at 77 K, followed analysis using gas chromy.;
rhodium In neat (no solvent) byproducts: CD4; methanation on Rh surface at 10**-8Torr and 150K using pulsed-laser image atom-probe; studying atomic steps of react.;; detn. react. intermediates by time-of-flight mass spectrum;;
12-molybdophosphoric acid
12026-57-2

12-molybdophosphoric acid

deuterium
16873-17-9

deuterium

A

PMo12O39(3-)

PMo12O39(3-)

B

water-d2
7789-20-0

water-d2

Conditions
ConditionsYield
In neat (no solvent) Kinetics; react. of H2-D2 over PMo12 at 573 K; initial pressures of H2: 12 Torr, D2 20 Torr; detn. of pressure decrease; evolved water detd. volumetrically;
nitrogen(II) oxide
10102-43-9

nitrogen(II) oxide

deuterium
16873-17-9

deuterium

A

nitrogen
7727-37-9

nitrogen

B

water-d2
7789-20-0

water-d2

Conditions
ConditionsYield
platinum 300 K;
oxygen
80937-33-3

oxygen

deuterium
16873-17-9

deuterium

A

water
7732-18-5

water

B

water-d2
7789-20-0

water-d2

Conditions
ConditionsYield
With air; hydrogen; LaNi5(2)H6.7 room temp.;A 0%
B n/a
oxygen
80937-33-3

oxygen

deuterium
16873-17-9

deuterium

water-d2
7789-20-0

water-d2

Conditions
ConditionsYield
copper(II) oxide In not given Kinetics;
nickel(II) oxide In not given Kinetics;
platinum Kinetics; water formation on Pt;
methane
34557-54-5

methane

carbon dioxide
124-38-9

carbon dioxide

deuterium
16873-17-9

deuterium

A

carbon monoxide
201230-82-2

carbon monoxide

B

water
7732-18-5

water

C

hydrogen
1333-74-0

hydrogen

D

water-d2
7789-20-0

water-d2

E

water
14940-63-7

water

Conditions
ConditionsYield
With catalyst:7 wtpercentNi/MgO In neat (no solvent) Kinetics; byproducts: HDO; 7 wt% Ni/MgO as catalyst, CH4:CO2:D2=1:1:0.2, 973 K, 16.7 kPa CH4 and CO2, resp., 3.3 kPa D2, 100 kPa total pressure, Ar as balance, HDO was also formed; monitored by MS;
deuterium
16873-17-9

deuterium

dinitrogen monoxide
10024-97-2

dinitrogen monoxide

A

nitrogen
7727-37-9

nitrogen

B

water-d2
7789-20-0

water-d2

Conditions
ConditionsYield
nickel Kinetics; at 124-192 °C,total pressure:15 mmHg;
With catalysts: Ir/Al2O3 Kinetics; at 393-473°C;
With catalysts: Pt/Al2O3 Kinetics; at 393-473°C;
tin(IV) oxide

tin(IV) oxide

deuterium
16873-17-9

deuterium

water-d2
7789-20-0

water-d2

Conditions
ConditionsYield
In not given byproducts: Sn; equilibrium constant discussed;;
In not given byproducts: Sn;
In not given byproducts: Sn;
deuteroxyl
13587-54-7

deuteroxyl

deuterium
16873-17-9

deuterium

A

water-d2
7789-20-0

water-d2

B

deuterium

deuterium

Conditions
ConditionsYield
In neat (no solvent) Kinetics;

Deuterium oxide History

In the year 1931, Harold Urey discovered the isotope deuterium and was later able to concentrate it in water. Urey's mentor Gilbert Newton Lewis isolated the first sample of pure heavy water by electrolysis in 1933. George de Hevesy and Hoffer used heavy water in 1934 in one of the first biological tracer experiments, to estimate the rate of turnover of water in the human body. The history of large-quantity production and use of heavy water in early nuclear experiments is given below.

Deuterium oxide Consensus Reports

EPA Genetic Toxicology Program. Reported in EPA TSCA Inventory.

Deuterium oxide Specification

The Heavy water with CAS registry number of 7789-20-0 is also known as Deuterium oxide. The IUPAC name is (2H2)water. It belongs to product categories of Inorganics; Heavy Water (Deuterium Oxide); Alphabetical Listings; D; Stable Isotopes. Its EINECS registry number is 232-148-9. In addition, the formula is D2O and the molecular weight is 20.03. The chemical is a colourless liquid and should be stored in sealed containers in cool, dry place. What's more, it is obtained by liquid hydrogen distillation. During using it, avoid contact with skin and eyes.

Physical properties about Heavy water are: (1)ACD/BCF (pH 5.5): 1; (2)ACD/BCF (pH 7.4): 1; (3)#H bond acceptors: 1; (4)#H bond donors: 2; (5)Index of Refraction: 1.329; (6)Molar Refractivity: 3.676 cm3; (7)Molar Volume: 18.045 cm3; (8)Polarizability: 1.457×10-24cm3; (9)Surface Tension: 72.269 dyne/cm; (10)Density: 1.11 g/cm3; (11)Enthalpy of Vaporization: 40.65 kJ/mol; (12)Boiling Point: 100 °C at 760 mmHg; (13)Vapour Pressure: 24.475 mmHg at 25 °C.

Uses of Heavy water: it is used in nuclear magnetic resonance spectroscopy when the solvent of interest is water and the nuclide of interest is hydrogen. It is often used as the source of deuterium for preparing specifically labelled isotopologs of organic compounds and used instead of water when collecting FTIR spectra of proteins in solution. What's more, it is used in certain types of nuclear reactors where it acts as a neutron moderator to slow down neutrons.

You can still convert the following datas into molecular structure:
1. SMILES: [2H]O[2H]
2. InChI: InChI=1/H2O/h1H2/i/hD2
3. InChIKey: XLYOFNOQVPJJNP-ZSJDYOACEI
4. Std. InChI: InChI=1S/H2O/h1H2/i/hD2
5. Std. InChIKey: XLYOFNOQVPJJNP-ZSJDYOACSA-N

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